TREXIO: A file format and library for quantum chemistry E Posenitskiy, VG Chilkuri, A Ammar, M Hapka, K Pernal, R Shinde, ...
The Journal of chemical physics 158 (17), 2023
20 2023 Extension of selected configuration interaction for transcorrelated methods A Ammar, A Scemama, E Giner
The Journal of Chemical Physics 157 (13), 2022
16 2022 Optimization of large determinant expansions in quantum Monte Carlo A Ammar, E Giner, A Scemama
Journal of Chemical Theory and Computation 18 (9), 5325-5336, 2022
15 2022 Can GW handle multireference systems? A Ammar, A Marie, M Rodríguez-Mayorga, HGA Burton, PF Loos
The Journal of Chemical Physics 160 (11), 2024
10 2024 The A Marie, A Ammar, PF Loos
arXiv preprint arXiv:2311.05351, 2023
10 2023 Biorthonormal Orbital Optimization with a Cheap Core-Electron-Free Three-Body Correlation Factor for Quantum Monte Carlo and Transcorrelation A Ammar, A Scemama, E Giner
Journal of Chemical Theory and Computation 19 (15), 4883-4896, 2023
10 2023 Transcorrelated selected configuration interaction in a bi-orthonormal basis and with a cheap three-body correlation factor A Ammar, A Scemama, E Giner
The Journal of Chemical Physics 159 (11), 2023
7 2023 Fitting continuum wavefunctions with complex Gaussians: Computation of ionization cross sections A Ammar, A Leclerc, LU Ancarani
Journal of Computational Chemistry 41 (27), 2365-2377, 2020
7 2020 A complex Gaussian approach to molecular photoionization A Ammar, LU Ancarani, A Leclerc
Journal of Computational Chemistry 42 (32), 2294-2305, 2021
5 2021 Go green: Selected configuration interaction as a more sustainable alternative for high accuracy PF Loos, Y Damour, A Ammar, M Caffarel, F Kossoski, A Scemama
arXiv preprint arXiv:2402.13111, 2024
3 2024 Multicenter integrals involving complex Gaussian-type functions A Ammar, A Leclerc, LU Ancarani
Advances in Quantum Chemistry 83, 287-304, 2021
3 2021 Compactification of Determinant Expansions via Transcorrelation A Ammar, A Scemama, PF Loos, E Giner
arXiv preprint arXiv:2405.02640, 2024
2 2024 Calculation of electron-impact and photoionization cross sections of methane using analytical Gaussian integrals A Ammar, A Leclerc, LU Ancarani
Physical Review A 109 (5), 052810, 2024
2 2024 Cumulant Green's function methods for molecules PF Loos, A Marie, A Ammar
Faraday Discussions, 2024
2 2024 Représentation des états du continuum par des gaussiennes complexes: application aux processus d’ionisation atomiques et moléculaires A Ammar
Université de Lorraine, 2020
1 2020 Selected configuration interaction using a transcorrelated Hamiltonian A Ammar, Y Damour, E Giner, PF Loos, A Scemama
Journées Théorie, Modélisation et Simulations-JTMS 2024, 2024
2024 Ionization of molecules using a Gaussian representation of the continuum states LU Ancarani, A Leclerc, A Ammar
APS Annual Gaseous Electronics Meeting Abstracts, GT2. 004, 2023
2023 On the use of complex GTOs for the evaluation of radial integrals involving oscillating functions A Ammar, A Leclerc, LU Ancarani
Advances in Quantum Chemistry 88, 133-149, 2023
2023 Representation of continuum states with complex Gaussians: Application to atomic and molecular ionization processes A Ammar
< bound method Organization. get_name_with_acronym of< Organization …, 2020
2020 ÉCOLE DOCTORALE C2MP A AMMAR
Anthony scemamaCNRS, Université Paul Sabatier, ToulouseZweryfikowany adres z irsamc.ups-tlse.fr
